4-Demethyl-6-O-methyldoxorubicin

Base Information

• Chemical Name: 4-Demethyl-6-O-methyldoxorubicin
• CAS No.: 97777-78-1
• Molecular Formula: C27H29NO11
• Molecular Weight: 543.5193
• DSSTox Substance ID: DTXSID10913657
• Mol file: 97777-78-1.mol

Synonyms:4-demethyl-6-O-methyldoxorubicin

Chemical Property of 4-Demethyl-6-O-methyldoxorubicin

Chemical Property:

• Vapor Pressure: 4.56E-31mmHg at 25°C
• Boiling Point: 854.3°Cat760mmHg
• Flash Point: 470.4°C
• PSA: 206.07000
• Density: 1.61g/cm³
• LogP: 0.70160
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 5
• Exact Mass: 543.17406074
• Heavy Atom Count: 39
• Complexity: 977

Purity/Quality:

99%min ^*data from raw suppliers

4-DEMETHYL-6-O-METHYLDOXORUBICIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(CC(O1)OC2C3=C(CCC2(C(=O)CO)O)C(=C4C(=C3OC)C(=O)C5=C(C4=O)C=CC=C5O)O)N)O